For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
7-ketocyclohepta-1,3,5-triene-1,3-dicarboxylic acid diethyl ester
SpectraBase Compound ID DHsFGvLDRrN
InChI InChI=1S/C13H14O5/c1-3-17-12(15)9-6-5-7-11(14)10(8-9)13(16)18-4-2/h5-8H,3-4H2,1-2H3
InChIKey GLHQXZYZCVKOBV-UHFFFAOYSA-N
Mol Weight 250.25 g/mol
Molecular Formula C13H14O5
Exact Mass 250.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JAQzZUUtkbi
Name 7-ketocyclohepta-1,3,5-triene-1,3-dicarboxylic acid diethyl ester
CAS Registry Number 136175-63-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O5
InChI InChI=1S/C13H14O5/c1-3-17-12(15)9-6-5-7-11(14)10(8-9)13(16)18-4-2/h5-8H,3-4H2,1-2H3
InChIKey GLHQXZYZCVKOBV-UHFFFAOYSA-N
Molecular Weight 250.250 g/mol
SMILES C1(=CC(C(=O)OCC)=CC=CC1=O)C(=O)OCC
SPLASH splash10-056r-3950000000-6e953e3b7ae20a61ef49
Source of Spectrum J-56-6445-5
Synonyms 7-Oxocyclohepta-1,3,5-triene-1,3-dicarboxylic acid diethyl ester Diethyl 7-oxidanylidenecyclohepta-1,3,5-triene-1,3-dicarboxylate Diethyl 7-oxo-1,3,5-cycloheptatriene-1,3-dicarboxylate Diethyl 7-oxocyclohepta-1,3,5-triene-1,3-dicarboxylate
Wiley ID 1253105